Geometry & MOs

Info

ID:	224404
PubChem CID:	85342511
Reduced:	NSiO6C20H33 (1)
Stoich.:	ABC6D20E33 (1)
Weight, g/mol:	412.188589
ΔH_f, kcal/mol:	-317.15
Dipole, Da:	1.41
IP(EA), eV:	-8.99(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[6-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2,2-dimethyl-1,3-dioxan-4-yl]ethenyl]-2-methoxyphenol

Drug info:

PubChemData

Smile

CC(C)[Si](C)(C)OC(C)C1C(C(C(O1)O)NC(=O)OCC2=CC=CC=C2)OC

DOS

IR

Vibrations